S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 2,2-bis(chloranyl)ethanethioate

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 2,2-bis(chloranyl)ethanethioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] 2,2-dichloroethanethioate CAS Name: 2,2-dichloroethanethioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] 2,2-dichloroethanethioate Traditional Name: 2,2-dichloroethanethioic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C13H21Cl2NO2S MolecularWeight: 326.28234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)C(Cl)Cl

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SC(=O)C(Cl)Cl

InChI

InChI=1S/C13H21Cl2NO2S/c1-2-3-4-5-6-7-9-16-11(17)8-10-19-13(18)12(14)15/h8,10,12H,2-7,9H2,1H3,(H,16,17)/b10-8+